N-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furanyl)-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[5-(2-furyl)-2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5)C

Isomeric SMILES

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5)C

InChI

InChI=1S/C24H27N5O3/c1-13-14(2)25-23(27-21(13)30)29-20(9-18(28-29)19-4-3-5-32-19)26-22(31)24-10-15-6-16(11-24)8-17(7-15)12-24/h3-5,9,15-17H,6-8,10-12H2,1-2H3,(H,26,31)(H,25,27,30)